CID 54593652

1-(2-methoxyethyl)piperidin-3-ol

Structural Information

Molecular Formula

C₈H₁₇NO₂

SMILES

COCCN1CCCC(C1)O

InChI

InChI=1S/C8H17NO2/c1-11-6-5-9-4-2-3-8(10)7-9/h8,10H,2-7H2,1H3

InChIKey

JPLSYUDDYUGXQU-UHFFFAOYSA-N

Compound name

1-(2-methoxyethyl)piperidin-3-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 159.12593 Da
Monoisotopic Mass: 0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	160.13321	135.8
[M+Na]+	182.11515	145.9
[M+NH4]+	177.15975	143.7
[M+K]+	198.08909	140.3
[M-H]-	158.11865	136.3
[M+Na-2H]-	180.10060	139.9
[M]+	159.12538	137.1
[M]-	159.12648	137.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe